# generated using pymatgen data_Hf8Ni21 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.40978900 _cell_length_b 7.98549741 _cell_length_c 8.52816391 _cell_angle_alpha 75.13001413 _cell_angle_beta 68.12599949 _cell_angle_gamma 75.46243674 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8Ni21 _chemical_formula_sum 'Hf8 Ni21' _cell_volume 385.60244609 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Hf Hf0 1 0.75303400 0.06301900 0.46578800 1.0 Hf Hf1 1 0.24696600 0.93698100 0.53421200 1.0 Hf Hf2 1 0.56881200 0.53662900 0.74530900 1.0 Hf Hf3 1 0.43118800 0.46337100 0.25469100 1.0 Hf Hf4 1 0.93022100 0.59668300 0.18552500 1.0 Hf Hf5 1 0.06977900 0.40331700 0.81447500 1.0 Hf Hf6 1 0.75219200 0.93776900 0.89272300 1.0 Hf Hf7 1 0.24780800 0.06223100 0.10727700 1.0 Ni Ni8 1 0.00000000 0.50000000 0.50000000 1.0 Ni Ni9 1 0.51431200 0.11747800 0.25795800 1.0 Ni Ni10 1 0.48568800 0.88252200 0.74204200 1.0 Ni Ni11 1 0.90088800 0.21720600 0.65467600 1.0 Ni Ni12 1 0.09911200 0.78279400 0.34532400 1.0 Ni Ni13 1 0.69618400 0.25458400 0.95851800 1.0 Ni Ni14 1 0.30381600 0.74541600 0.04148200 1.0 Ni Ni15 1 0.86364400 0.28891400 0.15713700 1.0 Ni Ni16 1 0.11905800 0.05381000 0.84989600 1.0 Ni Ni17 1 0.88094200 0.94619000 0.15010400 1.0 Ni Ni18 1 0.48330100 0.20615200 0.77636500 1.0 Ni Ni19 1 0.51669900 0.79384800 0.22363500 1.0 Ni Ni20 1 0.31924000 0.24269800 0.54871500 1.0 Ni Ni21 1 0.68076000 0.75730200 0.45128500 1.0 Ni Ni22 1 0.09864300 0.25839600 0.34713300 1.0 Ni Ni23 1 0.90135700 0.74160400 0.65286700 1.0 Ni Ni24 1 0.28687100 0.39064200 0.02867700 1.0 Ni Ni25 1 0.71312900 0.60935800 0.97132300 1.0 Ni Ni26 1 0.31651100 0.59905400 0.53705400 1.0 Ni Ni27 1 0.68348900 0.40094600 0.46294600 1.0 Ni Ni28 1 0.13635600 0.71108600 0.84286300 1.0